Found 26 hits Enz. Inhib. hit(s) with Target = 'Acetyl-CoA carboxylase 2 [27-2458]' and Ligand = 'BDBM220130' Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 2.03E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 2.03E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 2.33E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 2.33E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 2.51E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 2.51E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 2.53E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 2.53E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 2.75E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 2.75E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 2.86E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 2.86E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 3.13E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 3.13E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 3.32E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 3.32E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 3.36E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 3.36E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 3.93E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 3.93E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 4.54E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 4.54E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
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| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 5.14E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 5.14E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 5.20E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
Acetyl-CoA carboxylase 2 [27-2458]
(Homo sapiens (Human)) | BDBM220130
(US9278925, V.1-a | US9278925, V.3-a)Show SMILES CO[C@@]1(C)CC[C@@]2(CC1)NC(=O)C(=C2O)c1cc(ccc1C)-c1ccc(Cl)cc1 |r,wU:6.9,2.2,wD:2.1,c:13,(-6.65,-2.62,;-5.32,-1.85,;-5.32,-.31,;-6.65,.46,;-3.98,-1.08,;-2.65,-.31,;-2.65,1.23,;-3.98,2,;-5.32,1.23,;-2.65,2.77,;-1.18,3.25,;-.41,4.58,;-.28,2,;-1.18,.75,;-.41,-.58,;1.26,2,;2.03,.67,;3.57,.67,;4.34,2,;3.57,3.33,;2.03,3.33,;1.26,4.67,;4.34,-.67,;3.57,-2,;4.34,-3.33,;5.88,-3.33,;6.65,-4.67,;6.65,-2,;5.88,-.67,)| Show InChI InChI=1S/C24H26ClNO3/c1-15-4-5-17(16-6-8-18(25)9-7-16)14-19(15)20-21(27)24(26-22(20)28)12-10-23(2,29-3)11-13-24/h4-9,14,27H,10-13H2,1-3H3,(H,26,28)/t23-,24- | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 5.20E+3 | n/a | n/a | n/a | n/a | 7.5 | 22 |
BAYER INTELLECTUAL PROPERTY GMBH
US Patent
| Assay Description
For the assay, 50 nl of a 100-times concentrated solution of the test substance in DMSO were pipetted into a white low-volume 384-well microtitre pla... |
US Patent US9278925 (2016)
BindingDB Entry DOI: 10.7270/Q2VM4B3K |
More data for this
Ligand-Target Pair | |
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